17 search results - page 1 / 4 » Local Search Heuristic for Rigid Protein Docking |
WABI
2004
Springer
13 years 10 months ago
2004
Springer
Abstract. We give an algorithm that locally improves the fit between two proteins modeled as space-filling diagrams. The algorithm defines the fit in purely geometric terms and...
WCE
2007
13 years 5 months ago
2007
Abstract—Docking simulates molecular interactions. Protein - protein docking, owing to the sizes of molecules, is a very challenging problem. As the number of degrees of freedom ...
CP
2005
Springer
13 years 10 months ago
2005
Springer
In this paper we show how Constraint Programming (CP) techniques can improve the efficiency and applicability of grid-based algorithms for optimising surface contact between comple...
ICGA
1997
13 years 6 months ago
1997
Molecular docking software makes computational predictions of the interaction of molecules. This can be useful, for example, in evaluating the binding of candidate drug molecules ...
GECCO
2003
Springer
13 years 9 months ago
2003
Springer
We have developed an evolutionary approach for the flexible docking that is now an important component of a rational drug design. This automatic docking tool, referred to as the G...